ethyl 5-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-5-oxopentanoate
Chemical Structure Depiction of
ethyl 5-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-5-oxopentanoate
ethyl 5-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-5-oxopentanoate
Compound characteristics
| Compound ID: | V006-3757 |
| Compound Name: | ethyl 5-[4-({5-[(2'-cyano[1,1'-biphenyl]-4-yl)methoxy]-4-oxo-4H-pyran-2-yl}methyl)piperazin-1-yl]-5-oxopentanoate |
| Molecular Weight: | 543.62 |
| Molecular Formula: | C31 H33 N3 O6 |
| Salt: | not_available |
| Smiles: | CCOC(CCCC(N1CCN(CC1)CC1=CC(C(=CO1)OCc1ccc(cc1)c1ccccc1C#N)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.6434 |
| logD: | 2.6426 |
| logSw: | -3.1674 |
| Hydrogen bond acceptors count: | 11 |
| Polar surface area: | 87.027 |
| InChI Key: | FIXOLNGWFBJRNT-UHFFFAOYSA-N |